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CAS 77281-03-9 SodiuM 2-Methoxyethanesulfonate molecular structure lightbox
CAS RN: 77281-03-9

SodiuM 2-Methoxyethanesulfonate

  • Product code: SSC-186750
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 77281-03-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Beijing Inquiry
0.25g >95% 1 In Stock Shanghai Inquiry
1g >95% 1 In Stock Beijing Inquiry
5g >95% 0 Out of Stock Hong Kong Inquiry

77281-03-9 / sodium 2-methoxyethanesulfonate

Standard CAS: 77281-03-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
77281-03-9
Multi CAS
Yes
Molecular Formula
C3H7NAO4S
Molecular Weight
162.140000
Exact Mass
161.996274
InChI
InChI=1S/C3H8O4S.Na/c1-7-2-3-8(4,5)6;/h2-3H2,1H3,(H,4,5,6);/q;+1/p-1
InChIKey
NTNBAJGJIIVGGF-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
26.44
TPSA
66.43

LogP / Solubility

WLOGP
-3.82
MLOGP
-3.36
XLogP3
-3.82
Consensus LogP
-3.67
Log S (ESOL)
1.76
Class (ESOL)
Highly soluble
Log S (Ali)
1.87
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.1
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.42

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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